The finite element simulation of a selection of two-and three-dimensional flow problems is presented, based upon the use of four different constitutive models for polymer melts (Oldroyd-B, Rolie-Poly, Pom-Pom and XPP). The mathematical...
moreThe finite element simulation of a selection of two-and three-dimensional flow problems is presented, based upon the use of four different constitutive models for polymer melts (Oldroyd-B, Rolie-Poly, Pom-Pom and XPP). The mathematical and computational models are first introduced, before their application to a range of visco-elastic flows is described. Results demonstrate that the finite element models used here are able to re-produce predictions made by other published numerical simulations and, significantly, by carefully conducted physical experiments using a commercial-grade polystyrene melt in a three-dimensional contraction geometry. The paper also presents a systematic comparison and evaluation of the differences between two-and threedimensional simulations of two different flow regimes: flow of an Oldroyd-B fluid around a cylinder and flow of a Rolie-Poly fluid into the contraction geometry. This comparison allows new observations to be made concerning the relatively poor quality of two-dimensional simulations for flows in even quite deep channels. This paper describes the finite element simulation of a variety of two-and 2 three-dimensional flows of polymer melts, based upon the use of a selection of 3 single-and multi-mode constitutive models. In particular we investigate the 4 differences between two-and three-dimensional simulations as the channel 5 depth varies and compare predictions against carefully conducted experi-6 ments. The primary goals of the work are to increase our understanding 7 of three-dimensional effects of visco-elastic fluids in deep channels and to 8 demonstrate that the constitutive models that we use are capable of repro-9 ducing physical experiments conducted with a commercial-grade polystyrene 10 flowing into a contraction. The computational approach used is based upon 11 a finite element discretization that uses equal order approximations for each 12 of the dependent variables. The stability of this discretization is achieved 13 through a slight relaxation of the incompressibility condition based upon a 14 penalty formulation. The advantages and disadvantages of such an approach 15 are discussed, and its accuracy is verified via comparison with other published 16 results. 17 In recent years there have been important developments in the numerical 18 2 simulation of the flow of molten polymers. New constitutive equations that 19 describe the nonlinear dynamics of entangled polymer have been developed, 20 for example [36, 38, 37, 32], based upon the Doi-Edwards tube model for 21 entanglements. These models incorporate approximations of the molecular 22 scale processes of reptation and chain-stretch, with parameters that relate to 23 the molecular structure of polymers although, in practice, these parameters 24 are often fitted to rheological measurements. 25 In particular multimode versions of the Pompom model [37] are able to 26 reproduce the shear and extensional rheology of branched polymer melts. 27 The polymeric stress in this model is factorised into contributions from tube 28 orientation and backbone stretch that are governed by separate equations. 29 Although Wapperom and Keunings [54] computed the full integral model for 30 the tube orientation, most simulations have used a differential approximation 31 that uses an Oldroyd B equation for the orientation distribution. 32 Unlike for the Oldroyd B model, the polymer stress in the Pompom model 33 is bounded, so that this model does not have the same high Weissenberg 34 number problem [7]. However, the polymer stretch equation contains a con-35 ditional statement that the stretch cannot exceed the arm number q, which is 36 difficult to handle numerically. To avoid this difficulty a number of modified 37 versions have been introduced that do not include this condition, these in-38 clude the XPP [52] and DCPP[11] models. The absence of the maximum con-39 dition significantly alters the behaviour in extension and removes the process 40 of arm retraction in the original model. However, recent extensional mea-41 surements on a melt of Pompom molecules [43] find greater strain-hardening 42 than is permitted by the maximum stretch condition in the Pompom model.